The DINAMelt Server - free energy decomposition results for unnamed job 260420_044541
Loop Free-Energy Decomposition
ΔG = -3.6 kcal/mol ΔH = -38.4 kcal/mol ΔS = -116.6 e.u. Tm = -14.7°C
| Structural element | δδG | Information |
|---|---|---|
| External loop | -1.04 | 31 ss bases & 1 closing helices |
| Stack | -1.44 | External closing pair is G17-C20 |
| Stack | -0.99 | External closing pair is A18-T19 |
| Stack | -1.44 | External closing pair is T19-A18 |
| Helix | -3.86 | 4 base pairs |
| External loop | +1.26 | Closing pair is C20-G17 |
ΔG = -4.3 kcal/mol ΔH = -53.3 kcal/mol ΔS = -164.2 e.u. Tm = -5.3°C
| Structural element | δδG | Information |
|---|---|---|
| External loop | -2.00 | 39 ss bases & 1 closing helices |
| Stack | -1.40 | External closing pair is C27-G22 |
| Stack | -0.70 | External closing pair is T28-A21 |
| Helix | -2.10 | 3 base pairs |
| Interior loop | +1.92 | External closing pair is A29-T20 |
| Stack | -1.44 | External closing pair is G31-C17 |
| Stack | -1.58 | External closing pair is A32-T16 |
| Helix | -3.01 | 3 base pairs |
| External loop | +0.85 | Closing pair is C33-G15 |
ΔG = -4.1 kcal/mol ΔH = -32.0 kcal/mol ΔS = -93.5 e.u. Tm = -23.6°C
| Structural element | δδG | Information |
|---|---|---|
| External loop | -1.05 | 15 ss bases & 1 closing helices |
| Stack | -2.40 | External closing pair is G12-C31 |
| Stack | -1.40 | External closing pair is C13-G30 |
| Helix | -3.80 | 3 base pairs |
| External loop | +0.72 | Closing pair is T14-A29 |
ΔG = -3.2 kcal/mol ΔH = -24.4 kcal/mol ΔS = -71.2 e.u. Tm = -43.0°C
| Structural element | δδG | Information |
|---|---|---|
| External loop | -0.85 | 41 ss bases & 1 closing helices |
| Stack | -1.58 | External closing pair is A23-T16 |
| Stack | -1.59 | External closing pair is C24-G15 |
| Stack | -1.14 | External closing pair is A25-T14 |
| Helix | -4.30 | 4 base pairs |
| External loop | +1.99 | Closing pair is A26-T13 |
ΔG = -3.9 kcal/mol ΔH = -25.2 kcal/mol ΔS = -71.5 e.u. Tm = -36.1°C
| Structural element | δδG | Information |
|---|---|---|
| External loop | -1.37 | 29 ss bases & 1 closing helices |
| Stack | -2.40 | External closing pair is G12-C17 |
| Stack | -1.40 | External closing pair is C13-G16 |
| Helix | -3.80 | 3 base pairs |
| External loop | +1.29 | Closing pair is T14-A15 |
ΔG = -8.1 kcal/mol ΔH = -96.5 kcal/mol ΔS = -296.7 e.u. Tm = 18.0°C
| Structural element | δδG | Information |
|---|---|---|
| External loop | -1.37 | 15 ss bases & 1 closing helices |
| Stack | -2.40 | External closing pair is G12-C31 |
| Stack | -1.40 | External closing pair is C13-G30 |
| Helix | -3.80 | 3 base pairs |
| Bulge loop | +3.83 | External closing pair is T14-A29 |
| Stack | -0.99 | External closing pair is A15-T23 |
| Stack | -1.59 | External closing pair is T16-A22 |
| Stack | -1.44 | External closing pair is G17-C21 |
| Helix | -4.02 | 4 base pairs |
| Bulge loop | +2.40 | External closing pair is A18-T20 |
| Stack | -1.95 | External closing pair is C20-G19 |
| Stack | -1.40 | External closing pair is C21-G18 |
| Stack | -0.70 | External closing pair is T22-A17 |
| Stack | -1.58 | External closing pair is A23-T16 |
| Helix | -5.63 | 5 base pairs |
| External loop | +0.53 | Closing pair is C24-G15 |
ΔG = -5.8 kcal/mol ΔH = -42.8 kcal/mol ΔS = -124.2 e.u. Tm = -4.0°C
| Structural element | δδG | Information |
|---|---|---|
| External loop | -1.17 | 12 ss bases & 1 closing helices |
| Stack | -0.99 | External closing pair is A3-T25 |
| Stack | -1.14 | External closing pair is T4-A24 |
| Stack | -1.44 | External closing pair is T5-A23 |
| Stack | -1.95 | External closing pair is C6-G22 |
| Helix | -5.51 | 5 base pairs |
| External loop | +0.92 | Closing pair is C7-G21 |
ΔG = -4.8 kcal/mol ΔH = -34.7 kcal/mol ΔS = -100.2 e.u. Tm = -16.1°C
| Structural element | δδG | Information |
|---|---|---|
| External loop | -0.60 | 10 ss bases & 1 closing helices |
| Stack | -2.36 | External closing pair is C11-G35 |
| Stack | -2.40 | External closing pair is G12-C34 |
| Helix | -4.76 | 3 base pairs |
| External loop | +0.55 | Closing pair is C13-G33 |